Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.50 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.50 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.50 |
| ▸ | FADS1 | O60427 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | JAK1 | P23458 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | RORC | P51449 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8980390 | 0.79 | ALDH1A1 (0.53) | KDM4EALDH1A1HSD17B10GLAHPGD | |
| SCHEMBL5459120 | 0.79 | RORC (0.55) | KDM4EALDH1A1GLAHDAC1MAPT | |
| SCHEMBL9654244 | 0.78 | RECQL (0.71) | RECQLKDM4EALDH1A1MAPK13MAPK12 | |
| SCHEMBL29516764 | 0.78 | RECQL (1.00) | RECQLKDM4EALDH1A1MAPK14FADS1 | |
| SCHEMBL1261171 | 0.78 | RECQL (0.75) | RECQLKDM4EALDH1A1HSD17B10HPGD | |
| SCHEMBL29849818 | 0.78 | RECQL (0.75) | RECQLKDM4EALDH1A1HSD17B10HPGD | |
| SCHEMBL31597491 | 0.78 | MYC (0.56) | RECQLKDM4EALDH1A1HSD17B10GLA | |
| SCHEMBL333313 | 0.78 | RECQL (1.00) | RECQLKDM4EALDH1A1MAPK14FADS1 | |
| SCHEMBL258439 | 0.78 | MYC (0.56) | RECQLKDM4EALDH1A1HSD17B10GLA | |
| SCHEMBL2030008 | 0.78 | MYC (0.56) | RECQLKDM4EALDH1A1HSD17B10GLA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0072029-B1 | TRIAZOLOBENZAZEPINES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1986-10-22 | — | — | EP | disclosed |
| US-4464300-A | PSYCHOTROPIC, ANXIOLYTIC AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1984-08-07 | — | — | US | disclosed |
| EP-0072029-A2 | Triazolobenzazepines, process and intermediates for their preparation and medicines containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1983-02-16 | — | — | EP | disclosed |